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Monastrol structure, CAS 329689-23-8

Monastrol

CAS Number329689-23-8

Synonymsethyl 4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate; 5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(3-hydroxyphenyl)-6-methyl-2-thioxo-, ethyl ester; Ethyl 4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate; 5-pyrimidinecarboxylic acid, 1,6-dihydro-6-(3-hydroxyphenyl)-2-mercapto-4-methyl-, ethyl ester; 4-(3-Hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-4H-pyrimidin-5-carboxylic acid ethyl ester; Ethyl 6-(3-hydroxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate; Monastrol

Molecular FormulaC14H16N2O3S

Molecular Weight292.35

Purity≥95 (HPLC)%

Density1.3±0.1 g/cm3

Boiling Point441.3±55.0 °C at 760 mmHg

Melting Point

Flash Point

Appearancesolid

EINECS

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Symbol

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Cat. No.: 2A-9011489 Purity: ≥95 (HPLC)%
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Quality Control of [ 329689-23-8 ] Purity: ≥95 (HPLC)% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number329689-23-8
Catalog No.2A-9011489
Chinese Name星素
Synonymsethyl 4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate; 5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(3-hydroxyphenyl)-6-methyl-2-thioxo-, ethyl ester; Ethyl 4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate; 5-pyrimidinecarboxylic acid, 1,6-dihydro-6-(3-hydroxyphenyl)-2-mercapto-4-methyl-, ethyl ester; 4-(3-Hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-4H-pyrimidin-5-carboxylic acid ethyl ester; Ethyl 6-(3-hydroxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate; Monastrol
Molecular FormulaC14H16N2O3S
Molecular Weight292.35
Purity≥95 (HPLC)
Density1.3±0.1 g/cm3
Boiling Point441.3±55.0 °C at 760 mmHg
Appearancesolid
Storage ConditionSealed in a cool, dry environment
ApplicationMonastrol is a highly potent and cell-permeable inhibitor of the mitotic kinesin Eg5, with an IC50 value of 14 μM.
MDL NumberMFCD00813077
SMILESS=C1N[C@H](C(=C(N1)C)C(=O)OCC)c2cc(ccc2)O
InChI1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,12,17H,3H2,1-2H3,(H2,15,16,20)/t12-/m0/s1
InChI KeyLOBCDGHHHHGHFA-LBPRGKRZSA-N
NACRES CodeNA.32
UNSPSC12352200
MSDSmsds/11489_1_329689_23_8.pdf
Transport InfoProduct name: Monastrol
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